Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15544318 | 0.79 | TDP1 (0.56) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL12897291 | 0.78 | TDP1 (0.46) | TDP1ALDH1A1TSHRL3MBTL1KDM4E | |
| SCHEMBL14809555 | 0.76 | ALDH1A1 (0.45) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL12897304 | 0.76 | TDP1 (0.43) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL15177022 | 0.76 | TDP1 (0.43) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL16899790 | 0.75 | TDP1 (0.55) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL21950483 | 0.73 | TDP1 (0.53) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL16470913 | 0.73 | TDP1 (0.49) | TDP1ALDH1A1TSHRL3MBTL1POLB | |
| SCHEMBL13945637 | 0.73 | TDP1 (0.38) | TDP1ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL22454889 | 0.72 | ALDH1A1 (0.42) | TDP1ALDH1A1TSHRL3MBTL1POLB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112424179-A | Method for producing and separating 5-hydroxymethylfurfural by using quaternary ammonium salt | 诺瓦蒙特股份公司 | 2021-02-26 | — | — | CN | disclosed |